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Information card for entry 4130258
Preview
| Coordinates | 4130258.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H58 Cl10 N6 Ru3 |
|---|---|
| Calculated formula | C32 H58 Cl10 N6 Ru3 |
| Title of publication | Ru-Catalyzed C-H Arylation of Fluoroarenes with Aryl Halides. |
| Authors of publication | Simonetti, Marco; Perry, Gregory J. P.; Cambeiro, Xacobe C.; Juliá-Hernández, Francisco; Arokianathar, Jude N.; Larrosa, Igor |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2016 |
| Journal volume | 138 |
| Journal issue | 10 |
| Pages of publication | 3596 - 3606 |
| a | 21.221 ± 0.007 Å |
| b | 13.81 ± 0.004 Å |
| c | 9.163 ± 0.003 Å |
| α | 90° |
| β | 103.056 ± 0.007° |
| γ | 90° |
| Cell volume | 2615.9 ± 1.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 1 2/m 1 |
| Hall space group symbol | -C 2y |
| Residual factor for all reflections | 0.0867 |
| Residual factor for significantly intense reflections | 0.0656 |
| Weighted residual factors for significantly intense reflections | 0.2019 |
| Weighted residual factors for all reflections included in the refinement | 0.2187 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.092 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 240760 (current) | 2019-11-25 | cif/ Adding structures of 4130258 via cif-deposit CGI script. |
4130258.cif |
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Users of the data should acknowledge the original authors of the
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